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Goldmanite |
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Righter K, Sutton S, Danielson L, Pando K, Schmidt G, Yang H, |
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Berthet S, Newville M, Choi Y, Downs R T, Malavergne V |
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American Mineralogist 96 (2011) 1278-1290 |
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The effect of fO2 on the partitioning and valence of V and Cr in garnet/melt |
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pairs and the relation to terrestrial mantle V and Cr content |
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Locality: synthetic |
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Note: R090043 |
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_database_code_amcsd 0018453 |
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12.0790 12.0790 12.0790 90 90 90 Ia3d |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ca .125 0 .25 .969 .0074 .0061 .0080 .0080 0 0 .0014 |
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V 0 0 0 .967 .0053 .0053 .0053 .0053 .0002 .0002 .0002 |
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Si .375 0 .25 .0052 .0045 .0055 .0055 0 0 0 |
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O .0393 .0481 .6551 .0092 .0091 .0088 .0097 .0004 -.005 -.0002 |
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Goldmanite |
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Righter K, Sutton S, Danielson L, Pando K, Schmidt G, Yang H, |
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Berthet S, Newville M, Choi Y, Downs R T, Malavergne V |
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American Mineralogist 96 (2011) 1278-1290 |
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The effect of fO2 on the partitioning and valence of V and Cr in garnet/melt |
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pairs and the relation to terrestrial mantle V and Cr content |
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Locality: synthetic |
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Note: R090044 |
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_database_code_amcsd 0018454 |
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12.089 12.089 12.089 90 90 90 Ia3d |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ca .125 0 .25 .954 .0078 .0056 .0088 .0088 0 0 .0088 |
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V 0 0 0 .951 .0057 .0057 .0057 .0057 .0006 .0006 .0006 |
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Si .375 0 .25 .0054 .0042 .0060 .0060 0 0 0 |
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O .0392 .0476 .6549 .0118 .014 .010 .010 -.0003 -.0014 .0002 |
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Uvarovite |
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Righter K, Sutton S, Danielson L, Pando K, Schmidt G, Yang H, |
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Berthet S, Newville M, Choi Y, Downs R T, Malavergne V |
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American Mineralogist 96 (2011) 1278-1290 |
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The effect of fO2 on the partitioning and valence of V and Cr in garnet/melt |
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pairs and the relation to terrestrial mantle V and Cr content |
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Locality: Saranovskiy mine, Sarany, Ural Mountains, Russia |
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Note: R060477 |
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_database_code_amcsd 0018455 |
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11.9204 11.9204 11.9204 90 90 90 Ia3d |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ca .125 0 .25 .0026 .0014 .0032 .0032 0 0 .0007 |
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Cr 0 0 0 .575 .0067 .0067 .0067 .0067 .0001 .0001 .0001 |
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Al 0 0 0 .41 .0067 .0067 .0067 .0067 .0001 .0001 .0001 |
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Ti 0 0 0 .015 .0067 .0067 .0067 .0067 .0001 .0001 .0001 |
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Si .375 0 .25 .0032 .0036 .0031 .0031 0 0 0 |
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O .0388 .0466 .6526 .0097 .0079 .0104 .0005 -.0004 .0003 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Goldmanite |
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Righter K, Sutton S, Danielson L, Pando K, Schmidt G, Yang H, |
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Berthet S, Newville M, Choi Y, Downs R T, Malavergne V |
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American Mineralogist 96 (2011) 1278-1290 |
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The effect of fO2 on the partitioning and valence of V and Cr in garnet/melt |
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pairs and the relation to terrestrial mantle V and Cr content |
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Locality: Tetitice, Klatovy, Czechoslovakia |
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Note: R061138 |
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_database_code_amcsd 0018456 |
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12.0276 12.0276 12.0276 90 90 90 Ia3d |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ca .125 0 .25 .926 .0075 .0055 .0086 .0086 0 0 .0014 |
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Mn .125 0 .25 .043 .0075 .0055 .0086 .0086 0 0 .0014 |
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V 0 0 0 .81 .0050 .0050 .0050 .0050 .00007 .00007 .00007 |
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Al 0 0 0 .11 .0050 .0050 .0050 .0050 .00007 .00007 .00007 |
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Cr 0 0 0 .035 .0050 .0050 .0050 .0050 .00007 .00007 .00007 |
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Si .375 0 .25 .0040 .0045 .0037 .0037 0 0 0 |
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O .03911 .04795 .65489 .0082 .0084 .0083 .0079 .0002 -.0001 .0003 |
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View JMOL 3-D Structure
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Austinite |
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Clark L A, Pluth J J, Steele I M, Smith J V, Sutton S R |
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Mineralogical Magazine 61 (1997) 677-683 |
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Crystal structure of austinite, CaZn(AsO4)OH |
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Locality: Sonora, Mexico |
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_database_code_amcsd 0014530 |
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7.5092 9.0438 5.9343 90 90 90 P2_12_12_1 |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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As .62285 .67699 .51670 .00593 .00616 .00612 .00552 -.00080 -.00004 .00014 |
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Zn .23594 .49358 .24316 .00964 .0110 .0116 .0063 -.00114 .00099 .00167 |
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Ca .63121 .32805 .47712 .00977 .0104 .0076 .0114 .0007 .0011 .0005 |
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O1 .4475 .5587 .4900 .00105 .0110 .0108 .0098 -.0037 .0003 .0004 |
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O2 .7914 .5633 .5882 .00140 .0103 .0147 .0171 .0026 -.0025 .0007 |
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O3 .3500 .2678 .2309 .00107 .0121 .0116 .0083 .0026 .0010 -.0013 |
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O4 .3970 .2903 .7585 .00119 .0139 .0125 .0093 .0026 .0019 .0028 |
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O5 .1085 .4269 .5087 .0088 .0089 .0096 .0078 .0001 -.0001 .0011 |
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H .014 .473 .513 .027 |
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Fe4O5 |
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Lavina B, Dera P, Kim E, Meng Y, Downs R T, Weck P F, Sutton S R, Zhao Y |
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Proceedings of the National Academy of Sciences 108 (2011) 17281-17284 |
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Discovery of the recoverable high-pressure iron oxide Fe4O5 |
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Locality: synthetic |
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Note: P = 10 GPa |
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_database_code_amcsd 0018509 |
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2.8430 9.700 12.29 90 90 90 Cmcm |
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atom x y z Uiso |
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Fe1 0 0 0 .02 |
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Fe2 0 .2616 .1131 .02 |
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Fe3 0 .5048 .25 .02 |
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O1 0 .158 .25 .02 |
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O2 0 .365 .55 .02 |
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O3 0 .085 .643 .02 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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